| SpectraBase Spectrum ID |
KC4fa5foWP1 |
| Name |
1,3-Cyclobutanedicarboxylic acid, 1-cyano-4-[4-(2-cyano-3-methoxy-3-oxo-1-propenyl)phenyl]-2-[4-(3-methoxy-3-oxo-1-propenyl)phenyl]-, dimethyl ester, [1S-[1.alpha.,2.alpha.(E),3.beta.,4.beta.(E)]]- |
| Alternate Name(s) |
Dimethyl (1S,2S,3R,4S)-1-cyano-2-{4-[(1E)-2-cyano-3-methoxy-3-oxo-1-propenyl]phenyl}-4-{4-[(1E)-3-methoxy-3-oxo-1-propenyl]phenyl}-1,3-cyclobutanedicarboxylate
Methyl 1-cyano-3-methoxy carbonyl-3-(p-methyl-(E)-propenoate)phenyl-4-(p-methyl-2-cyano-(E))-propenoate)phenylcyclobutanoate |
| CAS Registry Number |
66965-65-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H26N2O8 |
| InChI |
InChI=1S/C30H26N2O8/c1-37-23(33)14-9-18-5-10-20(11-6-18)25-24(28(35)39-3)26(30(25,17-32)29(36)40-4)21-12-7-19(8-13-21)15-22(16-31)27(34)38-2/h5-15,24-26H,1-4H3/b14-9+,22-15+/t24-,25-,26-,30+/m1/s1 |
| InChIKey |
IOLRJDOTZSFJCW-PUKWESMMSA-N |
| Molecular Weight |
542.544 g/mol |
| SMILES |
[C@]1([C@](c2ccc(\C=C\C(=O)OC)cc2)([C@]([C@]1(c1ccc(\C=C\(C(=O)OC)C#N)cc1)[H])(C(=O)OC)[H])[H])(C(=O)OC)C#N |
| SPLASH |
splash10-006t-0090000000-aadc8a69d16089d44e66 |
| Source of Spectrum |
C-100-2843-0 |
| Wiley ID |
1404855 |
![1,3-Cyclobutanedicarboxylic acid, 1-cyano-4-[4-(2-cyano-3-methoxy-3-oxo-1-propenyl)phenyl]-2-[4-(3-methoxy-3-oxo-1-propenyl)phenyl]-, dimethyl ester, [1S-[1.alpha.,2.alpha.(E),3.beta.,4.beta.(E)]]-](/api/spectrum/KC4fa5foWP1/structure.png?h=300&w=458 "1,3-Cyclobutanedicarboxylic acid, 1-cyano-4-[4-(2-cyano-3-methoxy-3-oxo-1-propenyl)phenyl]-2-[4-(3-methoxy-3-oxo-1-propenyl)phenyl]-, dimethyl ester, [1S-[1.alpha.,2.alpha.(E),3.beta.,4.beta.(E)]]-")
